| SpectraBase Compound ID | 7F429x0ALMC |
|---|---|
| InChI | InChI=1S/C31H38N2O5/c1-4-33-16-29(17-38-27(36)20-8-5-6-9-23(20)32-18(2)34)12-7-13-30-22-14-19-10-11-21(25(22)26(19)35)31(37-3,28(30)33)15-24(29)30/h5-6,8-9,11,19,22,24-25,28H,4,7,10,12-17H2,1-3H3,(H,32,34)/t19-,22?,24+,25?,28-,29-,30+,31-/m0/s1 |
| InChIKey | RCEMJZRBCLKOMD-GCQDMUFMSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C31H38N2O5 |
| Exact Mass | 518.278072 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E0nCFDQwKdr |
|---|---|
| Name | TALASSICUMINE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H38N2O5 |
| InChI | InChI=1S/C31H38N2O5/c1-4-33-16-29(17-38-27(36)20-8-5-6-9-23(20)32-18(2)34)12-7-13-30-22-14-19-10-11-21(25(22)26(19)35)31(37-3,28(30)33)15-24(29)30/h5-6,8-9,11,19,22,24-25,28H,4,7,10,12-17H2,1-3H3,(H,32,34)/t19-,22?,24+,25?,28-,29-,30+,31-/m0/s1 |
| InChIKey | RCEMJZRBCLKOMD-GCQDMUFMSA-N |
| Literature Reference Author | J.YUE,J.XU,Y.CHEN,S.CHEN |
| Literature Reference Citation | PHYTOCHEM.,37,1467(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90435-7 |
| Molecular Weight | 518.653 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5727 |